Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | BCL9 | O00512 | 1/20 | 0.43 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL10621456 | 0.86 | LMNA (0.50) | TSHRALDH1A1LOXL2CYP2C19MEN1 | |
| SCHEMBL28629837 | 0.85 | TSHR (0.58) | TSHRALDH1A1LOXL2CYP2C19MEN1 | |
| SCHEMBL22179659 | 0.80 | LOXL2 (0.50) | TSHRALDH1A1LOXL2CYP2C19SLC6A2 | |
| SCHEMBL16367418 | 0.79 | TSHR (0.50) | TSHRALDH1A1LOXL2CYP2C19MEN1 | |
| SCHEMBL16367410 | 0.79 | TSHR (0.50) | TSHRALDH1A1LOXL2CYP2C19MEN1 | |
| SCHEMBL1625876 | 0.79 | MEN1 (0.56) | TSHRALDH1A1LOXL2CYP2C19MEN1 | |
| SCHEMBL1625885 | 0.79 | MEN1 (0.56) | TSHRALDH1A1LOXL2CYP2C19MEN1 | |
| SCHEMBL1625595 | 0.79 | MEN1 (0.56) | TSHRALDH1A1LOXL2CYP2C19MEN1 | |
| SCHEMBL1023274 | 0.78 | TSHR (0.57) | TSHRALDH1A1LOXL2CYP2C19MEN1 | |
| SCHEMBL16367406 | 0.78 | TSHR (0.49) | TSHRALDH1A1LOXL2CYP2C19MEN1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1492803-A1 | NEW ANALOGS OF NITROBENZYLTHIOINOSINE | Grünenthal GmbH (DE) | 2005-01-05 | — | — | EP | disclosed |
| WO-2003084975-A1 | NEW ANALOGS OF NITROBENZYLTHIOINOSINE | Grünenthal GmbH (DE) | 2003-10-16 | — | — | WO | disclosed |